dbacp02610
General Description
Peptide name : Cytotoxin drCT-1 (drCT-I; Fragment)
Source/Organism : Not found
Linear/Cyclic : Not found
Chirality : Not found
Sequence Information
Sequence : LKCNKLVPLFYKTCPAGKNL
Peptide length: 20
C-terminal modification: Not found
N-terminal modification : Not found
Non-natural peptide information: None
Activity Information
Assay type : Not specified
Assay time : Not found
Activity : Not found
Cell line : Not found
Cancer type : Not found
Other activity : Not found
Physicochemical Properties
Amino acid composition bar chart :
Molecular mass : 2250.7674 Dalton
Aliphatic index : 0.975
Instability index : 53.7955
Hydrophobicity (GRAVY) : 0.04
Isoelectric point : 9.5954
Charge (pH 7) : 3.7353
Aromaticity : 0.1
Molar extinction coefficient (cysteine, cystine): (1490, 1615)
Hydrophobic/hydrophilic ratio : 1.5
hydrophobic moment : -1.007
Missing amino acid : R,W,H,Q,M,I,E,S,D
Most occurring amino acid : L
Most occurring amino acid frequency : 4
Least occurring amino acid : V
Least occurring amino acid frequency : 1
Structural Information
3D structure :
Secondary structure fraction (Helix, Turn, Sheet): (0.4, 0.2, 0.4)
SMILES Notation: CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(C)C)C(C)C)[C@@H](C)O)C(=O)O
Secondary Structure :
| Method | Prediction |
|---|---|
| GOR | HTTTTCCCEEEECCCTTTCC |
| Chou-Fasman (CF) | HHHHEEEEEEECCCCCCCCC |
| Neural Network (NN) | HCCCCCCCCCCCCCCCCCCC |
| Joint/Consensus | CCCCCCCCEEECCCCCCCCC |
Molecular Descriptors and ADMET Properties
Molecular Descriptors: Click here to download
ADMET Properties: Click here to download
Cross Referencing databases
CancerPPD : Not available
ApIAPDB : Not available
CancerPPD2 ID : Not available
Reference
1 : Choudhury SR, et al. Purification, crystallization and preliminary X-ray structural studies of a 7.2 kDa cytotoxin isolated from the venom of Daboia russelli russelli of the Viperidae family. Acta Crystallogr Sect F Struct Biol Cryst Commun. 2006; 62:292-4. doi: 10.1107/S1744309106005963
Literature
Paper title : Purification, crystallization and preliminary X-ray structural studies of a 7.2 kDa cytotoxin isolated from the venom of Daboia russelli russelli of the Viperidae family.
Doi : https://doi.org/10.1107/S1744309106005963
Abstract : A cytotoxin (MW 7.2 kDa) from Indian Russell's viper (Daboia russelli russelli) venom possessing antiproliferative activity, cardiotoxicity, neurotoxicity and myotoxicity has been purified, characterized and crystallized. The crystals belong to the tetragonal space group P4(1), with unit-cell parameters a = b = 47.94, c = 50.2 A. Larger crystals, which diffracted to 1.5 A, were found to be twinned; diffraction data were therefore collected to 2.93 A resolution using a smaller crystal. Molecular-replacement calculations identified two molecules of the protein in the asymmetric unit, which is in accordance with the calculated VM value.